Terodiline

C₂₀H₂₇N — CID 23480

About Terodiline

Terodiline (PubChem CID 23480) has the molecular formula C₂₀H₂₇N and a molecular weight of 281.44 g/mol. Its IUPAC name is N-tert-butyl-4,4-diphenylbutan-2-amine.

Molecular Properties

• Compound Name: Terodiline
• PubChem CID: 23480
• Molecular Formula: C₂₀H₂₇N
• Molecular Weight: 281.44 g/mol
• Exact Mass: 281.21
• IUPAC Name: N-tert-butyl-4,4-diphenylbutan-2-amine
• SMILES: CC(CC(c1ccccc1)c1ccccc1)NC(C)(C)C
• InChI: InChI=1S/C20H27N/c1-16(21-20(2,3)4)15-19(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14,16,19,21H,15H2,1-4H3
• InChIKey: UISARWKNNNHPGI-UHFFFAOYSA-N
• XLogP: 4.99
• TPSA: 12.03 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 1
• Rotatable Bonds: 5
• Heavy Atoms: 21
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	281.44
LogP ≤ 5	4.99
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	1

Frequently Asked Questions

What is the IUPAC name of Terodiline?

The IUPAC name of Terodiline (CID 23480) is N-tert-butyl-4,4-diphenylbutan-2-amine.

What is the SMILES notation for Terodiline?

The canonical SMILES for Terodiline is CC(CC(c1ccccc1)c1ccccc1)NC(C)(C)C.

What is the InChIKey of Terodiline?

The InChIKey is UISARWKNNNHPGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N/c1-16(21-20(2,3)4)15-19(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14,16,19,21H,15H2,1-4H3.

What are the key properties of Terodiline?

Terodiline has a molecular weight of 281.44 g/mol, XLogP of 4.99, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for Terodiline is sourced from PubChem (CID 23480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 23480 — identifiers, structure, computed properties (public domain)
• DrugCentral drug card 2603 — approved-drug record (CC BY-SA 4.0)

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